SCHEMBL31300029

SCHEMBL31300029

CCCCCCCCN(C(=O)OC(C)(C)C)/C(=N\C(=O)OC(C)(C)C)n1cccn1

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 3/20 0.37
CNR1 P21554 1/20 0.32
CNR2 P34972 1/20 0.32
CPB2 Q96IY4 3/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL31300021 1.00 NOS1 (0.37) NOS1CNR1CNR2CPB2
SCHEMBL31300034 1.00 NOS1 (0.37) NOS1CNR1CNR2CPB2
SCHEMBL27182108 0.87 CPB2 (0.33) CPB2
SCHEMBL27410079 0.87 TSHR (0.33) NOS1
SCHEMBL18430958 0.87 TSHR (0.33) NOS1
SCHEMBL31300035 0.86
SCHEMBL24929994 0.85 TDP1 (0.38)
SCHEMBL17094153 0.85 TDP1 (0.38)
SCHEMBL21461635 0.82 ALDH1A1 (0.31)
SCHEMBL21461636 0.82 ALDH1A1 (0.31)

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025024883-A1 NOVEL BROAD SPECTRUM ANTIVIRAL AND ANTIMICROBIAL PEPTIDE MIMICS NEWSOUTH INNOVATIONS PTY LIMITED (AU) 2025-02-06 WO disclosed